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Atomic-orbital Based Ab-initio Computation at UStc
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pot_local_paw.h
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1#ifndef POTLOCALPAW_H
2#define POTLOCALPAW_H
3
5#include "pot_base.h"
6
7namespace elecstate
8{
9
10class PotLocal_PAW : public PotBase
11{
12 public:
14 {
15 this->fixed_mode = true;
16 this->dynamic_mode = false;
17 }
18
19 void cal_fixed_v(double* vl_pseudo) override;
20};
21
22} // namespace elecstate
23
24#endif
Definition pot_base.h:22
bool dynamic_mode
Definition pot_base.h:32
bool fixed_mode
Definition pot_base.h:31
Definition pot_local_paw.h:11
void cal_fixed_v(double *vl_pseudo) override
Definition pot_local_paw.cpp:14
PotLocal_PAW()
Definition pot_local_paw.h:13
Definition cal_dm.h:10